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90390-16-2

Basic Information
CAS No.: 90390-16-2
Name: n-(2,5-dichlorobenzyl)-n-methylamine
Article Data: 1
Molecular Structure:
Molecular Structure of 90390-16-2 (n-(2,5-dichlorobenzyl)-n-methylamine)
Formula: C8H9Cl2N
Molecular Weight: 190.072
Synonyms: 1-(2,5-Dichlorophenyl)-N-methylmethanamine;benzenemethanamine, 2,5-dichloro-N-methyl-;[(2,5-dichlorophenyl)methyl]methylamine;N-(2,5-dichlorobenzyl)-N-methylamine;
Density: 1.226 g/cm3
Boiling Point: 238.4 °C at 760 mmHg
Flash Point: 98 °C
PSA: 12.03000
LogP: 3.10370
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Specification

The N-(2,5-Dichlorobenzyl)-N-methylamine, with the CAS registry number 90390-16-2, has the systematic name of 1-(2,5-dichlorophenyl)-N-methylmethanamine. It belongs to the following product categories: Aminomethyl's; Phenyls & Phenyl-Het; Phenyls & Phenyl-Het. And the molecular formula of the chemical is C8H9Cl2N.

The characteristics of N-(2,5-Dichlorobenzyl)-N-methylamine are as followings: (1)ACD/LogP: 2.64; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 3.24 Å2; (7)Index of Refraction: 1.547; (8)Molar Refractivity: 49.18 cm3; (9)Molar Volume: 154.9 cm3; (10)Polarizability: 19.49×10-24cm3; (11)Surface Tension: 37.5 dyne/cm; (12)Density: 1.226 g/cm3; (13)Flash Point: 98 °C; (14)Enthalpy of Vaporization: 47.53 kJ/mol; (15)Boiling Point: 238.4 °C at 760 mmHg; (16)Vapour Pressure: 0.0424 mmHg at 25°C. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc1ccc(Cl)cc1CNC
(2)InChI: InChI=1/C8H9Cl2N/c1-11-5-6-4-7(9)2-3-8(6)10/h2-4,11H,5H2,1H3
(3)InChIKey: MBWHXHJPISASFP-UHFFFAOYAV